3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide

C26H25N3O2 — CID 55493250

IUPAC3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide
SMILESO=C(NCC1(c2ccccc2)CCC1)c1cccc(OCc2cn3ccccc3n2)c1
InChIInChI=1S/C26H25N3O2/c30-25(27-19-26(13-7-14-26)21-9-2-1-3-10-21)20-8-6-11-23(16-20)31-18-22-17-29-15-5-4-12-24(29)28-22/h1-6,8-12,15-17H,7,13-14,18-19H2,(H,27,30)
InChIKeyMELVYKOIEYRSMY-UHFFFAOYSA-N
MW411.51 g/mol
LogP4.76
Rot. Bonds7

About 3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide

3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide (PubChem CID 55493250) has the molecular formula C26H25N3O2 and a molecular weight of 411.51 g/mol. Its IUPAC name is 3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide.

Molecular Properties

Compound Name3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide
PubChem CID55493250
Molecular FormulaC26H25N3O2
Molecular Weight411.51 g/mol
Exact Mass411.19
IUPAC Name3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide
SMILESO=C(NCC1(c2ccccc2)CCC1)c1cccc(OCc2cn3ccccc3n2)c1
InChIInChI=1S/C26H25N3O2/c30-25(27-19-26(13-7-14-26)21-9-2-1-3-10-21)20-8-6-11-23(16-20)31-18-22-17-29-15-5-4-12-24(29)28-22/h1-6,8-12,15-17H,7,13-14,18-19H2,(H,27,30)
InChIKeyMELVYKOIEYRSMY-UHFFFAOYSA-N
XLogP4.76
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.51
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[3-(methylamino)propyl]benzamide
CID 119431980
N-[2-(ethylamino)ethyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide;dihydrochloride
CID 119507186
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-pentylbenzamide
CID 134009641
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(piperidin-3-ylmethyl)benzamide
CID 119462373
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-piperidin-4-ylbenzamide
CID 119388257
N-[(2-chlorophenyl)methyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 24542001
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[2-(3-methylphenoxy)ethyl]benzamide
CID 30582719
N-[(3,5-dimethoxyphenyl)methyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 55576832
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoate
CID 7063876
N-[2-(aminomethyl)cyclopentyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 119603057
[2-ethyl-2-(hydroxymethyl)pyrrolidin-1-yl]-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]methanone
CID 126791881
methyl 2-[[3-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]benzoyl]amino]acetate
CID 55848603

Frequently Asked Questions

What is the IUPAC name of 3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide?
The IUPAC name of 3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide (CID 55493250) is 3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide.
What is the SMILES notation for 3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide?
The canonical SMILES for 3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide is O=C(NCC1(c2ccccc2)CCC1)c1cccc(OCc2cn3ccccc3n2)c1.
What is the InChIKey of 3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide?
The InChIKey is MELVYKOIEYRSMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N3O2/c30-25(27-19-26(13-7-14-26)21-9-2-1-3-10-21)20-8-6-11-23(16-20)31-18-22-17-29-15-5-4-12-24(29)28-22/h1-6,8-12,15-17H,7,13-14,18-19H2,(H,27,30).
What are the key properties of 3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide?
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide has a molecular weight of 411.51 g/mol, XLogP of 4.76, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(1-phenylcyclobutyl)methyl]benzamide is sourced from PubChem (CID 55493250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).